Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL17646473 | 0.83 | CNR1 (0.46) | CNR1ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL19643323 | 0.81 | IDO1 (0.44) | ALDH1A1CA1CA2POLBSMN1; SMN2 | |
| SCHEMBL27570977 | 0.81 | CA1 (0.41) | MTNR1AMTNR1BALDH1A1KDM4ELMNA | |
| SCHEMBL19914916 | 0.80 | CNR1 (0.41) | CNR1MTNR1AMTNR1BALDH1A1KDM4E | |
| SCHEMBL16416372 | 0.80 | CA12 (0.51) | CA1CA2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL100897 | 0.79 | SMN1; SMN2 (0.45) | ALDH1A1LMNAMAPTHPGDCA1 | |
| SCHEMBL14141265 | 0.79 | NPC1 (0.59) | CNR1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL419646 | 0.79 | CNR1 (0.50) | CNR1ALDH1A1CA1CA2POLB | |
| SCHEMBL17661299 | 0.78 | CA2 (0.50) | CNR1LMNAMAPTCA1CA2 | |
| SCHEMBL236452 | 0.77 | CNR1 (0.54) | CNR1MTNR1AMTNR1BCA1CA2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6465485-B1 | SUCH AS 7-CYANO-2-(2-(1-(4-(2-INDOLYL)CARBOXAMIDO)CYCLO-HEXYL)ETHYL)-1,2,3,4 -TETRAHYDROISOQUINOLINE; ANTIPSYCHOTIC AGENTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-10-15 | — | — | US | disclosed |